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2002•Chemical Physics LettersRequires access

Time-dependent density functional study of the static second hyperpolarizability of BB-, NN- and BN-substituted C60

Lasse Jensen, Piet Th. van Duijnen, J. G. Snijders, Delano P. Chong

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Key concepts: Hyperpolarizability, Density functional theory, Doping, Fullerene, Acceptor, Chemistry, Computational chemistry, Materials science

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